N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine

C16H27N3 — CID 62285741

IUPACN-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1N1CCC(C)CC1
InChIInChI=1S/C16H27N3/c1-5-17-11-15-13(3)10-14(4)18-16(15)19-8-6-12(2)7-9-19/h10,12,17H,5-9,11H2,1-4H3
InChIKeyHRQYKZYQSNRORC-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.04
Rot. Bonds4

About N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine

N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine (PubChem CID 62285741) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
PubChem CID62285741
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1N1CCC(C)CC1
InChIInChI=1S/C16H27N3/c1-5-17-11-15-13(3)10-14(4)18-16(15)19-8-6-12(2)7-9-19/h10,12,17H,5-9,11H2,1-4H3
InChIKeyHRQYKZYQSNRORC-UHFFFAOYSA-N
XLogP3.04
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4,6-dimethyl-2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
CID 62286271
3-(chloromethyl)-4,6-dimethyl-2-(4-methylpiperidin-1-yl)pyridine
CID 61256984
[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 61175547
N-[[4,6-dimethyl-2-(3,4,5-trimethylpiperazin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 114539975
N-[[4,6-dimethyl-2-(4-methylazepan-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 63623032
N-[[4,6-dimethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3-pyridinyl]methyl]ethanamine
CID 66371401
N-[[2-(4-ethyl-4-methylpiperidin-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 63159924
N-[[4,6-dimethyl-2-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62284032
[4,6-dimethyl-2-(4-methylazepan-1-yl)-3-pyridinyl]methanol
CID 63622827
N-[[2-(4-ethylpiperidin-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]propan-1-amine
CID 62289436
1-[2-(4-ethylpiperidin-1-yl)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62289434
1-[4,6-dimethyl-2-(4-propan-2-ylpiperidin-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 103502957

Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine (CID 62285741) is N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine is CCNCc1c(C)cc(C)nc1N1CCC(C)CC1.
What is the InChIKey of N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The InChIKey is HRQYKZYQSNRORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-5-17-11-15-13(3)10-14(4)18-16(15)19-8-6-12(2)7-9-19/h10,12,17H,5-9,11H2,1-4H3.
What are the key properties of N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62285741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).